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BDBM50193983 1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]-2-cyano-3-[2-(propan-2-yl)phenyl]guanidine::CHEMBL218334

SMILES: CC(C)c1ccccc1NC(NC#N)=Nc1ccc(Cl)c(c1O)S(=O)(=O)N(C)C

InChI Key: InChIKey=MJYWNWXBXOJFTD-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50193983   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
C-X-C chemokine receptor type 1


(Homo sapiens (Human))
BDBM50193983
PNG
(1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]...)
Show SMILES CC(C)c1ccccc1NC(NC#N)=Nc1ccc(Cl)c(c1O)S(=O)(=O)N(C)C |w:14.15|
Show InChI InChI=1S/C19H22ClN5O3S/c1-12(2)13-7-5-6-8-15(13)23-19(22-11-21)24-16-10-9-14(20)18(17(16)26)29(27,28)25(3)4/h5-10,12,26H,1-4H3,(H2,22,23,24)
PDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.29E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]IL8 from CXCR1 expressed in CHO cells


Bioorg Med Chem Lett 16: 5513-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.042
BindingDB Entry DOI: 10.7270/Q2NV9HWD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50193983
PNG
(1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]...)
Show SMILES CC(C)c1ccccc1NC(NC#N)=Nc1ccc(Cl)c(c1O)S(=O)(=O)N(C)C |w:14.15|
Show InChI InChI=1S/C19H22ClN5O3S/c1-12(2)13-7-5-6-8-15(13)23-19(22-11-21)24-16-10-9-14(20)18(17(16)26)29(27,28)25(3)4/h5-10,12,26H,1-4H3,(H2,22,23,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 112n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [125I]IL8 from CXCR2 expressed in CHO cells


Bioorg Med Chem Lett 16: 5513-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.042
BindingDB Entry DOI: 10.7270/Q2NV9HWD
More data for this
Ligand-Target Pair